============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 3 1.000 67.669 -15.822 55.800 -99.200 -91.000 PHE 10 1.000 66.137 -19.066 45.599 -99.200 -91.000 TYR 14 0.840 71.064 -19.312 42.154 -99.200 -91.000 PHE 30 1.000 87.305 -50.828 55.812 -99.200 -91.000 TYR 61 0.840 97.079 -41.472 62.817 -99.200 -91.000 PHE 79 1.000 89.979 -23.075 57.955 -99.200 -91.000 TYR 91 0.840 92.869 -28.821 72.713 -99.200 -91.000 TYR 111 0.840 84.748 -16.674 53.095 -99.200 -91.000 TYR 114 0.840 80.122 -12.082 58.860 -99.200 -91.000 TYR 120 0.840 85.438 -21.040 51.024 -99.200 -91.000 PHE 126 1.000 86.894 -32.625 55.948 -99.200 -91.000 PHE 137 1.000 82.098 -36.392 61.125 -99.200 -91.000 TYR 148 0.840 76.125 -38.713 55.236 -99.200 -91.000 PHE 163 1.000 75.373 -50.717 44.262 -99.200 -91.000 TYR 168 0.840 77.359 -49.526 54.544 -99.200 -91.000 TYR 209 0.840 92.952 -42.257 55.277 -99.200 -91.000 TYR 212 0.840 93.113 -50.062 48.306 -99.200 -91.000 PHE 220 1.000 89.661 -54.331 45.213 -99.200 -91.000